SCHEMBL13239665

SCHEMBL13239665

BrCc1nc2cc(CCc3ccccc3)ccc2s1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
RAB9A P51151 6/20 0.41
NPC1 O15118 5/20 0.41
HPGD P15428 4/20 0.41
NFKB1 P19838 3/20 0.41
NFKB2 Q00653 3/20 0.41
RELA Q04206 3/20 0.41
STAT1 P42224 1/20 0.41
HDAC6 Q9UBN7 2/20 0.41
L3MBTL1 Q9Y468 3/20 0.39
MAPK1 P28482 2/20 0.39
UBE2T Q9NPD8 1/20 0.39
ASIC3 Q9UHC3 1/20 0.39
HSD17B10 Q99714 1/20 0.39
LOXL2 Q9Y4K0 1/20 0.39
EPHX2 P34913 1/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
PKM P14618 2/20 0.39
ALOX15 P16050 1/20 0.38
HTT P42858 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL203384 0.78 PIK3CA (0.44) KDM4ERAB9ANPC1HPGDNFKB1
SCHEMBL3237222 0.77 CYP3A4 (0.53) RAB9ANPC1HDAC6L3MBTL1MAPK1
SCHEMBL27720130 0.76 MAPT (0.50) KDM4ERAB9ANPC1HPGDNFKB1
SCHEMBL201697 0.75 NPC1 (0.48) RAB9ANPC1HDAC6L3MBTL1MAPK1
SCHEMBL190078 0.75 UBE2T (0.66) KDM4ERAB9ANPC1HPGDL3MBTL1
2-Phenethylbenzo[D]Thiazole SCHEMBL11795321 0.74 SMN1; SMN2 (0.59) RAB9ANPC1HPGDL3MBTL1MAPK1
SCHEMBL201370 0.74 DYRK1A (0.46) RAB9ANPC1HDAC6MAPK1UBE2T
SCHEMBL203263 0.72 MAPT (0.47) KDM4ERAB9ANPC1HDAC6MAPK1
SCHEMBL362555 0.72 DYRK1A (0.45) RAB9ANPC1HDAC6MAPK1LOXL2
SCHEMBL7461310 0.72 LOXL2 (0.70) RAB9ANPC1HDAC6LOXL2SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100173933-A1 ANTIBACTERIAL AGENTS PROLYSIS LTD (GB) 2010-07-08 US disclosed
US-20100173933-A1 ANTIBACTERIAL AGENTS PROLYSIS LTD (GB) 2010-07-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100173933-A1 ANTIBACTERIAL AGENTS ALK, ROS1, NOX1 KDM4E 2407/4885RAB9A 2799/4885NPC1 1400/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.